(1R)-1-(4-nitrophenyl)-2-piperidin-1-ium-1-yl-ethanol

Systemtic Name: (1R)-1-(4-nitrophenyl)-2-piperidin-1-ium-1-yl-ethanol Openeye Name: (1R)-1-(4-nitrophenyl)-2-piperidin-1-ium-1-yl-ethanol CAS Name: (1R)-1-(4-nitrophenyl)-2-(1-piperidin-1-iumyl)ethanol IUPAC Name: (1R)-1-(4-nitrophenyl)-2-piperidin-1-ium-1-ylethanol Traditional Name: (1R)-1-(4-nitrophenyl)-2-piperidin-1-ium-1-yl-ethanol Formula: C13H19N2O3+ MolecularWeight: 251.30156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H18N2O3/c16-13(10-14-8-2-1-3-9-14)11-4-6-12(7-5-11)15(17)18/h4-7,13,16H,1-3,8-10H2/p+1/t13-/m0/s1